2-((tert-butoxycarbonyl)amino)-3-(2-cyanophenyl)propanoic acid(WXC06816)


Chemical Name: 2-((tert-butoxycarbonyl)amino)-3-(2-cyanophenyl)propanoic acid(WXC06816)
CAS Number: 226924-21-6
Product Number: AG019F13(AG019F13)
Synonyms:
MDL No:
Molecular Formula: C15H18N2O4
Molecular Weight: 290.3144

Identification/Properties


Computed Properties
Molecular Weight:
290.319g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
290.127g/mol
Monoisotopic Mass:
290.127g/mol
Topological Polar Surface Area:
99.4A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
433
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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